methyl 3-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanoate

Systemtic Name: methyl 3-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanoate Openeye Name: methyl 3-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanoate CAS Name: 3-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanoate Traditional Name: 3-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]propionic acid methyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=C2SCCC(=O)OC)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SCCC(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C19H19N3O3S/c1-24-16-10-8-15(9-11-16)22-18(14-6-4-3-5-7-14)20-21-19(22)26-13-12-17(23)25-2/h3-11H,12-13H2,1-2H3